o-(Propylsulphonyl)benzenesulphonamide
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Basic information
- CAS
79792-96-4- Standard SMILES
CCCS(=O)(=O)c1ccccc1S(N)(=O)=O- InChIKey
IVWZZQBPALNKLG-UHFFFAOYSA-N- Molecular formula
- C9H13NO4S2
- Average molar mass
- 263.3 g/mol
- Monoisotopic mass
- 263.02860024
Names & identifiers
- Preferred name
- o-(Propylsulphonyl)benzenesulphonamide
- IUPAC
- 2-propylsulfonylbenzenesulfonamide
- English name
- o-(propylsulphonyl)benzenesulphonamide
- Molecular formula
- C9H13NO4S2
- Molecular weight
- 263.33382
Names & synonyms
79792-96-4o-(Propylsulphonyl)benzenesulphonamideEINECS 279-264-62-(Propane-1-sulfonyl)benzene-1-sulfonamideSCHEMBL10567062IVWZZQBPALNKLG-UHFFFAOYSA-NDTXSID901000735AKOS010998798NS000604342-Propylsulfonylbenzenesulfonamide
Database identifiers
- CAS
79792-96-4- PubChem CID
- 3018867
- DTXSID
DTXSID901000735- EC Number
- 279-264-6
- Nikkaji
- J320.160K
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 415
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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